2-methyl-1H-indole; propanedioic acid

Systemtic Name: 2-methyl-1H-indole; propanedioic acid Openeye Name: malonic acid; 2-methyl-1H-indole CAS Name: 2-methyl-1H-indole; propanedioic acid IUPAC Name: 2-methyl-1H-indole; propanedioic acid Traditional Name: malonic acid; 2-methyl-1H-indole Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2N1.C(C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC2=CC=CC=C2N1.C(C(=O)O)C(=O)O

InChI

InChI=1S/C9H9N.C3H4O4/c1-7-6-8-4-2-3-5-9(8)10-7;4-2(5)1-3(6)7/h2-6,10H,1H3;1H2,(H,4,5)(H,6,7)